4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid

C11H20N2O5 — CID 83100116

IUPAC4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid
SMILESCCNC(=O)C1COCCN1CC(O)CC(=O)O
InChIInChI=1S/C11H20N2O5/c1-2-12-11(17)9-7-18-4-3-13(9)6-8(14)5-10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16)
InChIKeyRNGQHRLTCZCJHQ-UHFFFAOYSA-N
MW260.29 g/mol
LogP-1.34
Rot. Bonds6

About 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid

4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid (PubChem CID 83100116) has the molecular formula C11H20N2O5 and a molecular weight of 260.29 g/mol. Its IUPAC name is 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid.

Molecular Properties

Compound Name4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid
PubChem CID83100116
Molecular FormulaC11H20N2O5
Molecular Weight260.29 g/mol
Exact Mass260.14
IUPAC Name4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid
SMILESCCNC(=O)C1COCCN1CC(O)CC(=O)O
InChIInChI=1S/C11H20N2O5/c1-2-12-11(17)9-7-18-4-3-13(9)6-8(14)5-10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16)
InChIKeyRNGQHRLTCZCJHQ-UHFFFAOYSA-N
XLogP-1.34
TPSA99.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-amino-2-methylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83106373
4-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-ethylmorpholine-3-carboxamide
CID 83097772
6-[3-(ethylcarbamoyl)morpholin-4-yl]hexanoic acid
CID 83100363
N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
CID 83103810
4-(3-amino-2-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83098381
4-(3-amino-3-oxopropyl)-N-ethylmorpholine-3-carboxamide
CID 83103716
4-[3-(ethylcarbamoyl)morpholin-4-yl]pentanoic acid
CID 83100771
3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 116657396
N-ethyl-4-(3-hydrazinyl-3-oxopropyl)morpholine-3-carboxamide
CID 83104053
2-[3-(ethylcarbamoyl)morpholin-4-yl]butanoic acid
CID 83099705
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83103608
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83103752

Frequently Asked Questions

What is the IUPAC name of 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid?
The IUPAC name of 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid (CID 83100116) is 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid.
What is the SMILES notation for 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid?
The canonical SMILES for 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid is CCNC(=O)C1COCCN1CC(O)CC(=O)O.
What is the InChIKey of 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid?
The InChIKey is RNGQHRLTCZCJHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5/c1-2-12-11(17)9-7-18-4-3-13(9)6-8(14)5-10(15)16/h8-9,14H,2-7H2,1H3,(H,12,17)(H,15,16).
What are the key properties of 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid?
4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid has a molecular weight of 260.29 g/mol, XLogP of -1.34, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid is sourced from PubChem (CID 83100116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).